Name: product
SMILES:
OC1(c2ccc(Br)cc2F)CCC1Molecular Processing
Molecular formula
C10H10BrFO
Molecular weight
245.09
Exact mass
243.9899
XLogP
2.96
TPSA
20.23
H-bond donors
1
H-bond acceptors
1
Rotatable bonds
1
Heavy atoms
13
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.4
Molar refractivity
51.85
Supplementary Information
Details werden geladen…
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